Information card for entry 1506710

Structure parameters

• Formula: C23 H37 N O8 S Si
• Calculated formula: C23 H37 N O8 S Si
• SMILES: [Si](O[C@@H]1[C@H](N(S(=O)(=O)c2ccc(cc2)C)C[C@@H](O)[C@H]1OC(=O)C)COC(=O)C)(C)(C)C(C)(C)C.[Si](O[C@H]1[C@@H](N(S(=O)(=O)c2ccc(cc2)C)C[C@H](O)[C@@H]1OC(=O)C)COC(=O)C)(C)(C)C(C)(C)C
• Title of publication: A stereoselective route toward polyhydoxylated piperidines. A total synthesis of (+/-)-deoxymannojirimycin.
• Authors of publication: Boglio, Cécile; Stahlke, Sebastian; Thorimbert, Serge; Malacria, Max
• Journal of publication: Organic letters
• Year of publication: 2005
• Journal volume: 7
• Journal issue: 22
• Pages of publication: 4851 - 4854
• a: 13.581 ± 0.0017 Å
• b: 14.205 ± 0.001 Å
• c: 14.361 ± 0.0018 Å
• α: 90°
• β: 98.096 ± 0.011°
• γ: 90°
• Cell volume: 2742.9 ± 0.5 ų
• Cell temperature: 250 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0506
• Weighted residual factors for all reflections included in the refinement: 0.1447
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No